Propofol

Propofol

SCHEMBL8935177

CC(C)c1cccc(C(C)C)c1O.Cl

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ

The experimentally established mechanism targets of Propofol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 known ✓ P14867 8/20 0.94
GABRB1 known ✓ P18505 5/20 0.94
GABRB2 known ✓ P47870 4/20 0.94
GABRG2 known ✓ P18507 2/20 0.94
GABRB3 known ✓ P28472 2/20 0.94
GABRA5 known ✓ P31644 1/20 0.94
GABRA3 known ✓ P34903 1/20 0.94
GABRA2 known ✓ P47869 1/20 0.94
GABRA4 known ✓ P48169 1/20 0.94
GABRA6 known ✓ Q16445 1/20 0.94
CA1 P00915 2/20 0.94
CA2 P00918 2/20 0.94
CYP1A2 P05177 2/20 0.94
CYP3A4 P08684 2/20 0.94
LMNA P02545 2/20 0.94
FAAH O00519 1/20 0.94
HPGD P15428 1/20 0.94
TSHR P16473 1/20 0.94
PTGS1 P23219 1/20 0.94
SLC6A2 P23975 1/20 0.94

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Propofol SCHEMBL4458729 1.00 GABRA1 (0.94) GABRA1GABRB1GABRB2CA1CA2
Propofol SCHEMBL6040021 0.97 GABRA1 (0.90) GABRA1GABRB1GABRB2CA1CA2
Propofol SCHEMBL36245 0.97 GABRA1 (1.00) GABRA1GABRB1GABRB2CA1CA2
Propofol SCHEMBL2414429 0.97 GABRA1 (1.00) GABRA1GABRB1GABRB2CA1CA2
Propofol SCHEMBL10968616 0.94 GABRA1 (0.94) GABRA1GABRB1GABRB2CA1CA2
Propofol SCHEMBL1033835 0.94 GABRA1 (0.94) GABRA1GABRB1GABRB2CA1CA2
Propofol SCHEMBL4088686 0.94 GABRA1 (0.94) GABRA1GABRB1GABRB2CA1CA2
Propofol SCHEMBL5087474 0.94 GABRA1 (0.94) GABRA1GABRB1GABRB2CA1CA2
Propofol SCHEMBL5036811 0.94 GABRA1 (0.94) GABRA1GABRB1GABRB2CA1CA2
Propofol SCHEMBL10968613 0.94 GABRA1 (0.94) GABRA1GABRB1GABRB2CA1CA2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116507327-A Chewable formulations 礼蓝动物保健有限公司 2023-07-28 CN disclosed
CN-112237907-B Water purification adsorption material and preparation method and application thereof 北京化工大学 2023-04-25 CN disclosed
CN-108601819-B Amelioration of systemic sclerosis with death receptor agonists 约翰霍普金斯大学 2022-03-15 CN disclosed
CN-112689516-A Use of anti-BCMA chimeric antigen receptors 细胞基因公司 2021-04-20 CN disclosed
CN-111479613-A Methods of administering chimeric antigen receptor immunotherapy 凯德药业股份有限公司 2020-07-31 CN disclosed
CN-1744908-A Amino acid-derived propofol prodrugs, compositions and uses thereof XENOPORT INC (US) 2006-03-08 CN disclosed
EP-0630261-A4 NEW CYCLODEXTRINS AND NEW FORMULATED DRUGS. AUSTRALIAN COMMERCIAL RESEARCH (AU) 1996-11-06 EP disclosed
EP-0630261-A1 NEW CYCLODEXTRINS AND NEW FORMULATED DRUGS AUSTRALIAN COMMERCIAL RESEARCH & DEVELOPMENT LIMITED (AU) 1994-12-28 EP disclosed
WO-1993017711-A1 NEW CYCLODEXTRINS AND NEW FORMULATED DRUGS AUSTRALIAN COMMERCIAL RESEARCH & DEVELOPMENT LIMITED (AU) 1993-09-16 WO disclosed